N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide

C17H28N4O3 — CID 56759297

IUPACN-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide
SMILESCN(CCN1CCCCC1)C(=O)c1cc(CN2CCOCC2)on1
InChIInChI=1S/C17H28N4O3/c1-19(7-8-20-5-3-2-4-6-20)17(22)16-13-15(24-18-16)14-21-9-11-23-12-10-21/h13H,2-12,14H2,1H3
InChIKeyFOJVRHVFQUVKQJ-UHFFFAOYSA-N
MW336.44 g/mol
LogP1.06
Rot. Bonds6

About N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide

N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide (PubChem CID 56759297) has the molecular formula C17H28N4O3 and a molecular weight of 336.44 g/mol. Its IUPAC name is N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide
PubChem CID56759297
Molecular FormulaC17H28N4O3
Molecular Weight336.44 g/mol
Exact Mass336.22
IUPAC NameN-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide
SMILESCN(CCN1CCCCC1)C(=O)c1cc(CN2CCOCC2)on1
InChIInChI=1S/C17H28N4O3/c1-19(7-8-20-5-3-2-4-6-20)17(22)16-13-15(24-18-16)14-21-9-11-23-12-10-21/h13H,2-12,14H2,1H3
InChIKeyFOJVRHVFQUVKQJ-UHFFFAOYSA-N
XLogP1.06
TPSA62.05 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide (CID 56759297) is N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide is CN(CCN1CCCCC1)C(=O)c1cc(CN2CCOCC2)on1.
What is the InChIKey of N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is FOJVRHVFQUVKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O3/c1-19(7-8-20-5-3-2-4-6-20)17(22)16-13-15(24-18-16)14-21-9-11-23-12-10-21/h13H,2-12,14H2,1H3.
What are the key properties of N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide?
N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 336.44 g/mol, XLogP of 1.06, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(morpholin-4-ylmethyl)-N-(2-piperidin-1-ylethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 56759297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).